Molecule structure of Methylmercury toluenesulfonate (CAS NO.63869-06-7):
IUPAC Name: Methyl-(4-methylphenyl)sulfonyloxymercury
Molecular Weight: 386.8182 g/mol
Molecular Formula: C8H10HgO3S
H-Bond Acceptor: 3
Rotatable Bond Count: 3
Exact Mass: 388.005691
MonoIsotopic Mass: 388.005691
Topological Polar Surface Area: 43.4
Heavy Atom Count: 13
Complexity: 237
Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)O[Hg]C
InChI: InChI=1S/C7H8O3S.CH3.Hg/c1-6-2-4-7(5-3-6)11(8,9)10;;/h2-5H,1H3,(H,8,9,10);1H3;/q;;+1/p-1
InChIKey of Methylmercury toluenesulfonate (CAS NO.63869-06-7): CQSKVTFBYKJFML-UHFFFAOYSA-M
1. | ipr-mus LD50:20 mg/kg | NHTIA7 Nordisk Hygienisk Tidskrift. Scandinavian Journal of Hygiene. 31 (1950),207. |
A poison by intraperitoneal route. When heated to decomposition it emits toxic vapors of SOx and Hg.
ACGIH TLV: TWA 0.1 mg(Hg)/m3 (skin)
Methylmercury toluenesulfonate (CAS NO.63869-06-7) is also named as Mercury, methyl(toluenesulfonato)- .
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